F0508-0632
TL;DR: F0508-0632 (CAS 391944-85-7) is a chemical compound with molecular formula C27H22BrClF3N5O4S and molecular weight 683.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-bromophenyl)-5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide
Also Known As: F0508-0632, N-{[4-(4-bromophenyl)-5-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethoxybenzamide, N-((4-(4-bromophenyl)-5-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-3,4-dimethoxybenzamide, N-[[4-(4-bromophenyl)-5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide, N-{[4-(p-bromophenyl)-5-{[N-2-chloro-5-(trifluoromethyl)phenylcarbamoyl]methylthio}-4H-1,2,4-triazol-3-yl]methyl}veratramide
| Molecular Formula | C27H22BrClF3N5O4S |
|---|---|
| Molecular Weight | 683.02 g/mol |
| LogP | 6.38 |
| Topological Polar Surface Area | 107.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 683.02167 |
| Heavy Atoms | 42 |
| Complexity | 1601.8778 |
Chemical Identifiers
| CAS Number | 391944-85-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=C(C=C3)Br)SCC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl)OC |
Product Overview
F0508-0632 (CAS 391944-85-7), with molecular formula C27H22BrClF3N5O4S and molecular weight 683.02 g/mol. IUPAC: N-[[4-(4-bromophenyl)-5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide.
Chemical Property Profile of F0508-0632
Property Insights of F0508-0632
The XLogP value of 6.38 indicates that F0508-0632 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.37 Ų falls within the moderate polarity range, balancing permeability and solubility for F0508-0632. Following Lipinski's Rule of Five, F0508-0632 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0508-0632?
The CAS number of F0508-0632 is 391944-85-7.
What is the molecular formula of F0508-0632?
The molecular formula of F0508-0632 is C27H22BrClF3N5O4S.
What is the molecular weight of F0508-0632?
The molecular weight of F0508-0632 is 683.02 g/mol.
Where can I buy F0508-0632?
You can request a quote for F0508-0632 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0508-0632?
Yes, KEHONG BIO provides custom synthesis services for F0508-0632 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.